CID 21988066

2-amino-3-cyclobutylpropanoic acid hydrochloride

Structural Information

Molecular Formula
C7H13NO2
SMILES
C1CC(C1)CC(C(=O)O)N
InChI
InChI=1S/C7H13NO2/c8-6(7(9)10)4-5-2-1-3-5/h5-6H,1-4,8H2,(H,9,10)
InChIKey
SRGOJUDAJKUDAZ-UHFFFAOYSA-N
Compound name
2-amino-3-cyclobutylpropanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

702
Patents

143.09464 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.101916 134.2
[M+Na]+ 166.083858 137.3
[M-H]- 142.087364 135.4
[M+NH4]+ 161.128463 147.4
[M+K]+ 182.057798 139.9
[M+H-H2O]+ 126.091900 123.2
[M+HCOO]- 188.092841 153.2
[M+CH3COO]- 202.108491 178.0
[M+Na-2H]- 164.069306 136.1
[M]+ 143.09409142 138.6
[M]- 143.09518858 138.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe